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211099-97-7 | Phenol, 2,3-dimethoxy-6-[(4-phenyl-1-piperazinyl)methyl]-
CAS No: 211099-97-7 Catalog No: AG002L5A MDL No:
Product Description
Catalog Number:
AG002L5A
Chemical Name:
Phenol, 2,3-dimethoxy-6-[(4-phenyl-1-piperazinyl)methyl]-
CAS Number:
211099-97-7
Molecular Formula:
C19H24N2O3
Molecular Weight:
328.4055
IUPAC Name:
2,3-dimethoxy-6-[(4-phenylpiperazin-1-yl)methyl]phenol
InChI:
InChI=1S/C19H24N2O3/c1-23-17-9-8-15(18(22)19(17)24-2)14-20-10-12-21(13-11-20)16-6-4-3-5-7-16/h3-9,22H,10-14H2,1-2H3
InChI Key:
OPQZGXBLYYITOM-UHFFFAOYSA-N
SMILES:
COc1c(OC)ccc(c1O)CN1CCN(CC1)c1ccccc1
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.179g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
328.412g/mol
Monoisotopic Mass:
328.179g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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